SCHEMBL30445262

SCHEMBL30445262

COc1ccc(-c2nc3ccccc3o2)cc1NC(=S)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ LMNA P02545 2/20 0.57
▸ TP53 P04637 7/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ HTT P42858 1/20 0.51
▸ NPC1 O15118 1/20 0.50
▸ HDAC3 O15379 1/20 0.49
▸ HDAC4 P56524 1/20 0.49
▸ HDAC1 Q13547 1/20 0.49
▸ HDAC7 Q8WUI4 1/20 0.49
▸ HDAC2 Q92769 1/20 0.49
▸ HDAC10 Q969S8 1/20 0.49
▸ HDAC11 Q96DB2 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25257379 1.00 MAPT (0.63) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL25209983 0.90 MAPT (0.78) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL30445554 0.90 MAPT (0.78) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL30445802 0.83 MAPT (0.66) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL25232353 0.83 MAPT (0.66) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL25257561 0.79 MAPT (0.62) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL30445856 0.79 MAPT (0.62) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL25211272 0.79 TP53 (0.65) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL30445476 0.79 TP53 (0.65) MAPTSMN1; SMN2LMNATP53ALDH1A1
SCHEMBL25232386 0.77 MAPT (0.63) MAPTSMN1; SMN2LMNATP53ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172913-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-06-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230172913-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS TARBP1, NFATC1, TARDBP MAPT 781/4885SMN1; SMN2 4842/4885LMNA 1510/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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